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  • Currently displaying 2741 - 2760 of 30438 publications
Author(s)
Publication title
Journal Name
Publication year
Magnetically driven preparation of 1-D nano-necklaces capable of MRI relaxation enhancement
AM King, T Insinna, CJR Wells, IA Raby, YK Gun'ko, G-L Davies
Nanoscale advances
(2023)
5
Self-assembly of achiral building blocks into chiral cyclophanes using non-directional interactions
Y Zhang, B Ourri, P-T Skowron, E Jeamet, T Chetot, C Duchamp, AM Belenguer, N Vanthuyne, O Cala, E Dumont, PK Mandal, I Huc, F Perret, L Vial, J Leclaire
Chemical Science
(2023)
14
Branch Unit Distribution Matters for Gene Delivery.
Y Li, Z He, X Wang, Z Li, M Johnson, R Foley, A Sigen, J Lyu, W Wang
ACS Macro Lett
(2023)
12
Simulating organic aerosol in Delhi with WRF-Chem using the volatility-basis-set approach: exploring model uncertainty with a Gaussian process emulator
E Reyes-Villegas, D Lowe, JS Johnson, KS Carslaw, E Darbyshire, M Flynn, JD Allan, H Coe, Y Chen, O Wild, S Archer-Nicholls, A Archibald, S Singh, M Shrivastava, RA Zaveri, V Singh, G Beig, R Sokhi, G McFiggans
Atmospheric Chemistry and Physics
(2023)
23
Chemo-mechanical analysis of lithiation/delithiation of Ni-rich single crystals
SS Pandurangi, DS Hall, CP Grey, VS Deshpande, NA Fleck
Journal of the Electrochemical Society
(2023)
170
Explaining Blood–Brain Barrier Permeability of Small Molecules by Integrated Analysis of Different Transport Mechanisms
FMG Cornelissen, G Markert, G Deutsch, M Antonara, N Faaij, I Bartelink, D Noske, WP Vandertop, A Bender, BA Westerman
J Med Chem
(2023)
66
Anion redox as a means to derive layered manganese oxychalcogenides with exotic intergrowth structures.
S Sasaki, S Giri, SJ Cassidy, S Dey, M Batuk, D Vandemeulebroucke, G Cibin, RI Smith, P Holdship, CP Grey, J Hadermann, SJ Clarke
Nature Communications
(2023)
14
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
G Li Manni, I Fdez Galván, A Alavi, F Aleotti, F Aquilante, J Autschbach, D Avagliano, A Baiardi, JJ Bao, S Battaglia, L Birnoschi, A Blanco-González, SI Bokarev, R Broer, R Cacciari, PB Calio, RK Carlson, R Carvalho Couto, L Cerdán, LF Chibotaru, NF Chilton, JR Church, I Conti, S Coriani, J Cuéllar-Zuquin, RE Daoud, N Dattani, P Decleva, C de Graaf, MG Delcey, L De Vico, W Dobrautz, SS Dong, R Feng, N Ferré, M Filatov Gulak, L Gagliardi, M Garavelli, L González, Y Guan, M Guo, MR Hennefarth, MR Hermes, CE Hoyer, M Huix-Rotllant, VK Jaiswal, A Kaiser, DS Kaliakin, M Khamesian, DS King, V Kochetov, M Krośnicki, AA Kumaar, ED Larsson, S Lehtola, M-B Lepetit, H Lischka, P López Ríos, M Lundberg, D Ma, S Mai, P Marquetand, ICD Merritt, F Montorsi, M Mörchen, A Nenov, VHA Nguyen, Y Nishimoto, MS Oakley, M Olivucci, M Oppel, D Padula, R Pandharkar, QM Phung, F Plasser, G Raggi, E Rebolini, M Reiher, I Rivalta, D Roca-Sanjuán, T Romig, AA Safari, A Sánchez-Mansilla, AM Sand, I Schapiro, TR Scott, J Segarra-Martí, F Segatta, D-C Sergentu, P Sharma, R Shepard, Y Shu, JK Staab, TP Straatsma, LK Sørensen, BNC Tenorio, DG Truhlar, L Ungur, M Vacher, V Veryazov, TA Voß, O Weser, D Wu, X Yang, D Yarkony, C Zhou, JP Zobel, R Lindh
Journal of Chemical Theory and Computation
(2023)
19
NMR Methodology for Measuring Dissolved O2 and Transport in Lithium–Air Batteries
E Wang, E Jónsson, CP Grey
The Journal of Physical Chemistry C
(2023)
127
Label-free detection of proteins with optofluidic hollow-core photonic crystal fibre sensors
JR Heck, E Miele, R Mouthaan, MH Frosz, TPJ Knowles, TG Euser
SPIE Future Sensing Technologies 2023
(2023)
12327
Impact of HO2 aerosol uptake on radical levels and O3 production during summertime in Beijing
JE Dyson, LK Whalley, EJ Slater, R Woodward-Massey, C Ye, JD Lee, F Squires, JR Hopkins, RE Dunmore, M Shaw, JF Hamilton, AC Lewis, SD Worrall, A Bacak, A Mehra, TJ Bannan, H Coe, CJ Percival, B Ouyang, CN Hewitt, RL Jones, LR Crilley, LJ Kramer, WJF Acton, WJ Bloss, S Saksakulkrai, J Xu, Z Shi, RM Harrison, S Kotthaus, S Grimmond, Y Sun, W Xu, S Yue, L Wei, P Fu, X Wang, SR Arnold, DE Heard
Atmospheric Chemistry and Physics
(2023)
23
Analysing ill-conditioned Markov chains
EJ Woods, D Kannan, DJ Sharpe, TD Swinburne, DJ Wales
Philos Trans A Math Phys Eng Sci
(2023)
381
Supercomputing modelling of advanced materials: Preface
CRA Catlow, NH De Leeuw, A Michaelides, SM Woodley
Philosophical transactions. Series A, Mathematical, physical, and engineering sciences
(2023)
381
Nanoplasmonic Decoration of Sacrificial Bacteria: Directing Interparticle Coupling Toward Multiplex Analysis of Antiseptic Alcohols
M Ghamsari, N Fahimi-Kashani, MR Hormozi-Nezhad
ACS Applied Materials & Interfaces
(2023)
15
Energy landscapes and heat capacity signatures for monomers and dimers of amyloid forming hexapeptides
Nicy, DJ Wales
(2023)
Physics Inspired Approaches To Understanding Gaussian Processes
MP Niroomand, L Dicks, EO Pyzer-Knapp, DJ Wales
(2023)
Hydrogen production via electrolysis: Operandu monitoring and analyses
BY Kaplan, AC Kırlıoğlu, M Alinezhadfar, MA Zabara, NR Mojarrad, B Iskandarani, A Yürüm, CS Ozkan, M Ozkan, SA Gürsel
Chem Catalysis
(2023)
3
Solar-driven liquid multicarbon fuel production using a standalone perovskite-BiVO4 artificial leaf
M Rahaman, V Andrei, D Wright, E Lam, C Pornrungroj, S Bhattacharjee, C Pichler, H Greer, J Baumberg, E Reisner
Nature Energy
(2023)
8
Considerably Increased Dynamics of CO-Water Complexes over CO and Water Alone
C Bertram, C Zaum, W Fang, A Michaelides, K Morgenstern
Nano Letters
(2023)
23
Oxa-di-π-methane Rearrangement of a Substrate Embodying the Platencin Core Provides the Decahydro-1 H -cyclopenta[ c ]indene Framework Associated with Various Diterpenes and Certain Lycopodium Alkaloids
MG Banwell, SY Ye, F Khan, MG Gardiner, P Lan
Synlett
(2023)
34